SCHEMBL9997409

SCHEMBL9997409

O=C(O)[C@H](Cc1ccc(O)cc1)N(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.50
ANPEP P15144 2/20 0.42
ERAP2 Q6P179 2/20 0.42
ERAP1 Q9NZ08 2/20 0.42
LAP3 P28838 1/20 0.42
ENPEP Q07075 1/20 0.42
CA2 P00918 2/20 0.40
ESR1 P03372 2/20 0.40
ESR2 Q92731 1/20 0.40
POLB P06746 1/20 0.40
CAMK2A Q9UQM7 1/20 0.40
MME P08473 1/20 0.39
ACE P12821 1/20 0.39
FOLH1 Q04609 1/20 0.39
NAALAD2 Q9Y3Q0 1/20 0.39
CA1 P00915 1/20 0.38
TAAR1 Q96RJ0 2/20 0.38
SLC6A2 P23975 1/20 0.38
PTPRC P08575 1/20 0.38
LMNA P02545 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7025165 1.00 SLC7A5 (0.50) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL8933122 0.84 SLC7A5 (0.47) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL8933363 0.84 SLC7A5 (0.47) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL15453748 0.81 SLC7A5 (0.45) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL15453746 0.81 SLC7A5 (0.45) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL6036855 0.81 SLC7A5 (0.49) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL2992448 0.81 SLC7A5 (0.47) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL2992444 0.81 SLC7A5 (0.47) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL1486794 0.79 ANPEP (0.48) SLC7A5ANPEPERAP2ERAP1LAP3
SCHEMBL1486797 0.79 ANPEP (0.48) SLC7A5ANPEPERAP2ERAP1LAP3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2585487-B1 COINCIDENCE DETECTION KING S COLLEGE LONDON (GB) 2016-05-18 EP disclosed
US-20160083784-A1 COINCIDENCE DETECTION KING'S COLLEGE LONDON (GB) 2016-03-24 US disclosed
US-9150904-B2 Coincidence detection KING'S COLLEGE LONDON (GB) 2015-10-06 US disclosed
US-20130171644-A1 COINCIDENCE DETECTION KING'S COLLEGE LONDON (GB) 2013-07-04 US disclosed
EP-2585487-A2 COINCIDENCE DETECTION King's College London (GB) 2013-05-01 EP disclosed
WO-2011161420-A2 COINCIDENCE DETECTION KING'S COLLEGE LONDON (GB) 2011-12-29 WO disclosed